2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole

C16H10ClN3O — CID 137185111

IUPAC2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole
SMILESClc1ccc2[nH]c(-c3nnc(-c4ccccc4)o3)cc2c1
InChIInChI=1S/C16H10ClN3O/c17-12-6-7-13-11(8-12)9-14(18-13)16-20-19-15(21-16)10-4-2-1-3-5-10/h1-9,18H
InChIKeyJPTPAWILYOXLOD-UHFFFAOYSA-N
MW295.73 g/mol
LogP4.54
Rot. Bonds2

About 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole

2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole (PubChem CID 137185111) has the molecular formula C16H10ClN3O and a molecular weight of 295.73 g/mol. Its IUPAC name is 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole
PubChem CID137185111
Molecular FormulaC16H10ClN3O
Molecular Weight295.73 g/mol
Exact Mass295.05
IUPAC Name2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole
SMILESClc1ccc2[nH]c(-c3nnc(-c4ccccc4)o3)cc2c1
InChIInChI=1S/C16H10ClN3O/c17-12-6-7-13-11(8-12)9-14(18-13)16-20-19-15(21-16)10-4-2-1-3-5-10/h1-9,18H
InChIKeyJPTPAWILYOXLOD-UHFFFAOYSA-N
XLogP4.54
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.73
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1H-indol-2-yl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 137308252
3-[5-(1H-indol-2-yl)-1,3,4-oxadiazol-2-yl]-N,N-dimethylaniline
CID 137308248
3-(5-chloro-1H-indol-2-yl)aniline
CID 39347249
2-(4-chlorophenyl)-5-(2-phenyl-1H-indol-3-yl)-1,3,4-oxadiazole
CID 136746094
2-(chloromethyl)-5-(1H-indol-2-yl)-1,3,4-oxadiazole
CID 137153670
2,5-bis[4-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-1,3,4-oxadiazole
CID 101440187
2-[(6-chloro-1H-benzimidazol-2-yl)sulfanylmethyl]-5-phenyl-1,3,4-oxadiazole
CID 653645
2-(3,5-dichloro-1-benzothiophen-2-yl)-5-phenyl-1,3,4-oxadiazole
CID 11501120
3-(5-chloro-1H-indol-2-yl)benzoyl chloride
CID 20556621
1-(6-azaspiro[2.5]octan-6-yl)-2-[[5-(5-chloro-1H-indol-2-yl)-1,3,4-oxadiazol-2-yl]amino]ethanone
CID 171632231
ethane;2-phenyl-5-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-1,3,4-oxadiazole
CID 144770943
2-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-indol-5-ol
CID 135894697

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole?
The IUPAC name of 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole (CID 137185111) is 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole?
The canonical SMILES for 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole is Clc1ccc2[nH]c(-c3nnc(-c4ccccc4)o3)cc2c1.
What is the InChIKey of 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole?
The InChIKey is JPTPAWILYOXLOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClN3O/c17-12-6-7-13-11(8-12)9-14(18-13)16-20-19-15(21-16)10-4-2-1-3-5-10/h1-9,18H.
What are the key properties of 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole?
2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole has a molecular weight of 295.73 g/mol, XLogP of 4.54, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-1H-indol-2-yl)-5-phenyl-1,3,4-oxadiazole is sourced from PubChem (CID 137185111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).